CHEMBL34762
| SMILES | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(Br)cc3)nc2c1=O |
| InChIKey | RXFILCYMWCQBBJ-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 362.0 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| A2A | AA2AR | Rat | Adenosine | A | pKi | 7.24 | 7.24 | 7.24 | ChEMBL |
| A1 | AA1R | Rat | Adenosine | A | pKi | 7.89 | 7.89 | 7.89 | ChEMBL |
| A2B | AA2BR | Human | Adenosine | A | pKi | 8.57 | 8.57 | 8.57 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |